data_16043 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; The solution structure of Bacillus subtilis SR211 by NMR spectroscopy ; _BMRB_accession_number 16043 _BMRB_flat_file_name bmr16043.str _Entry_type original _Submission_date 2008-11-25 _Accession_date 2008-11-25 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'The solution structure of Bacillus subtilis SR211 by NMR spectroscopy' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mercier Kelly A. . 2 Mueller Geoffrey A. . 3 Powers Robert . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 570 "13C chemical shifts" 477 "15N chemical shifts" 119 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-11-12 update BMRB 'complete entry citation' 2009-07-22 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '(1)H, (13)C, and (15)N NMR assignments for the Bacillus subtilis yndB START domain.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19888688 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mercier Kelly A. . 2 Mueller Geoffrey A. . 3 Acton Thomas B. . 4 Xiao Rong . . 5 Montelione Gaetano T. . 6 Powers Robert . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 3 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 191 _Page_last 194 _Year 2009 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name SR211 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label SR211 $SR211 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_SR211 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common SR211 _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 152 _Mol_residue_sequence ; MAQNNENALPDITKSITLEA PIQKVWETVSTSEGIAKWFM PNDFQLKEGQEFHLQSPFGP SPCKVLAVQAPTELSFEWDT EGWVVTFQLEDLGEKTGFTL IHSGWKEPNQVIGKANEKSS VVRGKMDGGWTGIVNERLRK AVEELEHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 GLN 4 ASN 5 ASN 6 GLU 7 ASN 8 ALA 9 LEU 10 PRO 11 ASP 12 ILE 13 THR 14 LYS 15 SER 16 ILE 17 THR 18 LEU 19 GLU 20 ALA 21 PRO 22 ILE 23 GLN 24 LYS 25 VAL 26 TRP 27 GLU 28 THR 29 VAL 30 SER 31 THR 32 SER 33 GLU 34 GLY 35 ILE 36 ALA 37 LYS 38 TRP 39 PHE 40 MET 41 PRO 42 ASN 43 ASP 44 PHE 45 GLN 46 LEU 47 LYS 48 GLU 49 GLY 50 GLN 51 GLU 52 PHE 53 HIS 54 LEU 55 GLN 56 SER 57 PRO 58 PHE 59 GLY 60 PRO 61 SER 62 PRO 63 CYS 64 LYS 65 VAL 66 LEU 67 ALA 68 VAL 69 GLN 70 ALA 71 PRO 72 THR 73 GLU 74 LEU 75 SER 76 PHE 77 GLU 78 TRP 79 ASP 80 THR 81 GLU 82 GLY 83 TRP 84 VAL 85 VAL 86 THR 87 PHE 88 GLN 89 LEU 90 GLU 91 ASP 92 LEU 93 GLY 94 GLU 95 LYS 96 THR 97 GLY 98 PHE 99 THR 100 LEU 101 ILE 102 HIS 103 SER 104 GLY 105 TRP 106 LYS 107 GLU 108 PRO 109 ASN 110 GLN 111 VAL 112 ILE 113 GLY 114 LYS 115 ALA 116 ASN 117 GLU 118 LYS 119 SER 120 SER 121 VAL 122 VAL 123 ARG 124 GLY 125 LYS 126 MET 127 ASP 128 GLY 129 GLY 130 TRP 131 THR 132 GLY 133 ILE 134 VAL 135 ASN 136 GLU 137 ARG 138 LEU 139 ARG 140 LYS 141 ALA 142 VAL 143 GLU 144 GLU 145 LEU 146 GLU 147 HIS 148 HIS 149 HIS 150 HIS 151 HIS 152 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-22 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2KEW "The Solution Structure Of Bacillus Subtilis Sr211 Start Domain By Nmr Spectroscopy" 100.00 152 100.00 100.00 2.24e-106 PDB 2KTE "The Solution Structure Of Bacillus Subtilis, Yndb, Northeast Structural Genomics Consoritum Target Sr211" 100.00 152 99.34 100.00 8.05e-106 DBJ BAI85452 "hypothetical protein BSNT_08350 [Bacillus subtilis subsp. natto BEST195]" 94.74 144 99.31 100.00 8.15e-99 DBJ BAM52425 "hypothetical protein BEST7613_3494 [Bacillus subtilis BEST7613]" 94.74 144 99.31 100.00 8.15e-99 DBJ BAM58001 "hypothetical protein BEST7003_1800 [Bacillus subtilis BEST7003]" 94.74 144 99.31 100.00 8.15e-99 DBJ GAK81575 "hypothetical protein BSMD_034910 [Bacillus subtilis Miyagi-4]" 94.74 144 99.31 100.00 8.15e-99 EMBL CAB13657 "putative stress-related ATPase [Bacillus subtilis subsp. subtilis str. 168]" 94.74 144 99.31 100.00 8.15e-99 EMBL CCU58384 "hypothetical protein BSUBE1_1753 [Bacillus subtilis E1]" 94.74 144 97.92 99.31 6.64e-98 EMBL CEI56962 "hypothetical protein BS49_19660 [Bacillus subtilis]" 94.74 144 99.31 100.00 8.15e-99 EMBL CEJ77386 "hypothetical protein BS34A_19650 [Bacillus sp.]" 94.74 144 99.31 100.00 8.15e-99 EMBL CJT03957 "Activator of Hsp90 ATPase homolog 1-like protein [Streptococcus pneumoniae]" 94.74 144 98.61 100.00 2.80e-98 GB ADV92673 "hypothetical protein BSn5_00185 [Bacillus subtilis BSn5]" 94.74 144 97.92 99.31 6.64e-98 GB AFQ57707 "Putative stress-related ATPase [Bacillus subtilis QB928]" 94.74 144 99.31 100.00 8.15e-99 GB AGA21279 "Hypothetical protein YndB [Bacillus subtilis subsp. subtilis str. BSP1]" 94.74 144 99.31 100.00 8.15e-99 GB AGE63615 "hypothetical protein C663_1826 [Bacillus subtilis XF-1]" 94.74 144 97.92 98.61 1.20e-96 GB AGG61147 "YndB [Bacillus subtilis subsp. subtilis 6051-HGW]" 94.74 144 99.31 100.00 8.15e-99 REF NP_389656 "hypothetical protein BSU17730 [Bacillus subtilis subsp. subtilis str. 168]" 94.74 144 99.31 100.00 8.15e-99 REF WP_003231627 "MULTISPECIES: hypothetical protein [Bacillus]" 94.74 144 99.31 100.00 8.15e-99 REF WP_015383753 "hypothetical protein [Bacillus subtilis]" 94.74 144 97.92 98.61 1.20e-96 REF WP_015713997 "MULTISPECIES: hypothetical protein [Bacillus]" 94.74 144 97.92 99.31 6.64e-98 REF WP_017697365 "hypothetical protein [Bacillus subtilis]" 94.74 144 98.61 99.31 7.99e-98 SP O31806 "RecName: Full=Uncharacterized protein YndB" 94.74 144 99.31 100.00 8.15e-99 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $SR211 'Bacillus subtilis' 1423 Bacteria . Bacillus subtilis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $SR211 'recombinant technology' . Escherichia coli . MVK stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $SR211 1 mM '[U-100% 13C; U-100% 15N]' MES 20 mM 'natural abundance' D2O 5 % 'natural abundance' H2O 95 % 'natural abundance' 'sodium azide' 0.02 % 'natural abundance' DTT 10 mM 'natural abundance' 'sodium chloride' 100 mM 'natural abundance' 'calcium chloride' 5 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Saveframe_category software _Name ARIA _Version . loop_ _Vendor _Address _Electronic_address 'Linge, O'Donoghue and Nilges' . . stop_ loop_ _Task 'data analysis' refinement 'structure solution' stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_NMRDraw _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 750 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_HNHA_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_1 save_ save_3D_HCCH-COSY_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' .105 . M pH 6.5 . pH pressure 1 . atm temperature 277 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio water C 13 protons ppm 4.964 na indirect . . . 0.251449530 water H 1 protons ppm 4.694 internal direct . . . 1 water N 15 protons ppm 4.964 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $NMRView stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '2D 1H-13C HSQC' '3D CBCA(CO)NH' '3D C(CO)NH' '3D HNCO' '3D HNCA' '3D HNCACB' '3D HN(CO)CA' '3D HCCH-TOCSY' '3D HNHA' '3D HCCH-COSY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name SR211 _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 3 3 GLN C C 174.0810 . 1 2 4 4 ASN H H 8.4990 . 1 3 4 4 ASN HA H 4.6230 . 1 4 4 4 ASN HB2 H 2.7460 . 2 5 4 4 ASN HB3 H 2.7850 . 2 6 4 4 ASN C C 172.1100 . 1 7 4 4 ASN CA C 53.2960 . 1 8 4 4 ASN CB C 38.9590 . 1 9 4 4 ASN N N 109.5750 . 1 10 5 5 ASN H H 8.3930 . 1 11 5 5 ASN HA H 4.6820 . 1 12 5 5 ASN HB2 H 2.7230 . 2 13 5 5 ASN HB3 H 2.7860 . 2 14 5 5 ASN C C 173.0170 . 1 15 5 5 ASN CA C 53.2960 . 1 16 5 5 ASN CB C 38.3270 . 1 17 5 5 ASN N N 119.0680 . 1 18 6 6 GLU H H 8.5850 . 1 19 6 6 GLU HA H 4.1660 . 1 20 6 6 GLU HB2 H 1.9420 . 2 21 6 6 GLU HG2 H 2.2020 . 2 22 6 6 GLU C C 173.4550 . 1 23 6 6 GLU CA C 57.5550 . 1 24 6 6 GLU CB C 29.8830 . 1 25 6 6 GLU CG C 36.1700 . 1 26 6 6 GLU N N 122.0990 . 1 27 7 7 ASN H H 8.3630 . 1 28 7 7 ASN HA H 4.7290 . 1 29 7 7 ASN HB2 H 2.8400 . 2 30 7 7 ASN HB3 H 2.6440 . 2 31 7 7 ASN C C 172.0080 . 1 32 7 7 ASN CA C 52.9650 . 1 33 7 7 ASN CB C 39.3990 . 1 34 7 7 ASN N N 117.4140 . 1 35 8 8 ALA H H 7.6080 . 1 36 8 8 ALA HA H 4.2450 . 1 37 8 8 ALA HB H 1.0800 . 1 38 8 8 ALA C C 174.7520 . 1 39 8 8 ALA CA C 52.4190 . 1 40 8 8 ALA CB C 19.4180 . 1 41 8 8 ALA N N 122.3640 . 1 42 9 9 LEU H H 7.6780 . 1 43 9 9 LEU HA H 4.3200 . 1 44 9 9 LEU HB2 H 1.7830 . 2 45 9 9 LEU HG H 0.9800 . 1 46 9 9 LEU CA C 53.3590 . 1 47 9 9 LEU CB C 42.0880 . 1 48 9 9 LEU CD1 C 25.4280 . 2 49 9 9 LEU CG C 26.9220 . 1 50 9 9 LEU N N 121.5210 . 1 51 10 10 PRO HA H 4.4680 . 1 52 10 10 PRO HB2 H 2.2550 . 2 53 10 10 PRO HB3 H 1.8330 . 2 54 10 10 PRO HG2 H 1.7770 . 2 55 10 10 PRO C C 173.7810 . 1 56 10 10 PRO CA C 61.8950 . 1 57 10 10 PRO CB C 32.1540 . 1 58 10 10 PRO CG C 26.9790 . 1 59 11 11 ASP H H 8.4790 . 1 60 11 11 ASP HA H 4.6010 . 1 61 11 11 ASP HB2 H 2.3120 . 2 62 11 11 ASP C C 175.5170 . 1 63 11 11 ASP CA C 55.4230 . 1 64 11 11 ASP CB C 40.2430 . 1 65 11 11 ASP N N 120.5120 . 1 66 12 12 ILE H H 8.4490 . 1 67 12 12 ILE HA H 4.2160 . 1 68 12 12 ILE HB H 1.8400 . 1 69 12 12 ILE HG2 H 0.9300 . 1 70 12 12 ILE C C 172.4710 . 1 71 12 12 ILE CA C 61.4090 . 1 72 12 12 ILE CB C 40.2970 . 1 73 12 12 ILE CG1 C 27.2720 . 1 74 12 12 ILE CG2 C 17.5800 . 1 75 12 12 ILE N N 122.7750 . 1 76 13 13 THR H H 8.3760 . 1 77 13 13 THR HA H 5.5480 . 1 78 13 13 THR HB H 3.8720 . 1 79 13 13 THR HG2 H 1.0100 . 1 80 13 13 THR C C 171.3300 . 1 81 13 13 THR CA C 59.8380 . 1 82 13 13 THR CB C 71.0490 . 1 83 13 13 THR CG2 C 20.4000 . 1 84 13 13 THR N N 121.4150 . 1 85 14 14 LYS H H 8.7980 . 1 86 14 14 LYS HA H 4.8300 . 1 87 14 14 LYS HB2 H 1.7010 . 2 88 14 14 LYS HB3 H 1.9130 . 2 89 14 14 LYS C C 172.0820 . 1 90 14 14 LYS CA C 53.0460 . 1 91 14 14 LYS CB C 35.3000 . 1 92 14 14 LYS CD C 27.9520 . 1 93 14 14 LYS CG C 24.0980 . 1 94 14 14 LYS N N 122.8400 . 1 95 15 15 SER H H 8.5070 . 1 96 15 15 SER HA H 5.7840 . 1 97 15 15 SER HB2 H 3.7760 . 2 98 15 15 SER HB3 H 3.5840 . 2 99 15 15 SER C C 170.7030 . 1 100 15 15 SER CA C 57.1870 . 1 101 15 15 SER CB C 66.1370 . 1 102 15 15 SER N N 116.5680 . 1 103 16 16 ILE H H 9.1410 . 1 104 16 16 ILE HA H 4.5730 . 1 105 16 16 ILE HB H 1.8660 . 1 106 16 16 ILE HD1 H 0.7760 . 1 107 16 16 ILE HG12 H 0.8340 . 2 108 16 16 ILE HG13 H 1.4870 . 2 109 16 16 ILE HG2 H 0.7460 . 1 110 16 16 ILE C C 170.3660 . 1 111 16 16 ILE CA C 60.6240 . 1 112 16 16 ILE CB C 42.2020 . 1 113 16 16 ILE CD1 C 15.5190 . 1 114 16 16 ILE CG1 C 28.1650 . 1 115 16 16 ILE CG2 C 16.8390 . 1 116 16 16 ILE N N 121.5840 . 1 117 17 17 THR H H 8.4940 . 1 118 17 17 THR HA H 4.8920 . 1 119 17 17 THR HB H 3.9090 . 1 120 17 17 THR HG2 H 0.9670 . 1 121 17 17 THR C C 171.2280 . 1 122 17 17 THR CA C 62.0970 . 1 123 17 17 THR CB C 68.8790 . 1 124 17 17 THR CG2 C 22.4960 . 1 125 17 17 THR N N 121.4630 . 1 126 18 18 LEU H H 9.3260 . 1 127 18 18 LEU HA H 4.4920 . 1 128 18 18 LEU HB2 H 1.4140 . 2 129 18 18 LEU HB3 H 1.6750 . 2 130 18 18 LEU HD1 H 1.4530 . 2 131 18 18 LEU HD2 H 0.5630 . 2 132 18 18 LEU HG H 1.0860 . 1 133 18 18 LEU C C 174.2290 . 1 134 18 18 LEU CA C 53.0460 . 1 135 18 18 LEU CB C 44.6810 . 1 136 18 18 LEU CD1 C 26.9610 . 2 137 18 18 LEU CG C 26.8540 . 1 138 18 18 LEU N N 128.1620 . 1 139 19 19 GLU H H 9.6800 . 1 140 19 19 GLU HA H 4.2430 . 1 141 19 19 GLU HB2 H 1.6930 . 2 142 19 19 GLU HB3 H 2.0610 . 2 143 19 19 GLU HG2 H 2.2150 . 2 144 19 19 GLU C C 171.6900 . 1 145 19 19 GLU CA C 54.8620 . 1 146 19 19 GLU CB C 26.6810 . 1 147 19 19 GLU CG C 35.7640 . 1 148 19 19 GLU N N 127.0500 . 1 149 20 20 ALA H H 8.0010 . 1 150 20 20 ALA HA H 4.5650 . 1 151 20 20 ALA HB H 0.9750 . 1 152 20 20 ALA CA C 50.2270 . 1 153 20 20 ALA CB C 20.9530 . 1 154 20 20 ALA N N 123.7810 . 1 155 21 21 PRO HA H 4.3570 . 1 156 21 21 PRO HB2 H 2.3280 . 2 157 21 21 PRO HB3 H 2.1200 . 2 158 21 21 PRO HD2 H 3.3710 . 2 159 21 21 PRO HD3 H 3.7520 . 2 160 21 21 PRO HG2 H 2.0190 . 2 161 21 21 PRO HG3 H 1.8970 . 2 162 21 21 PRO C C 176.3670 . 1 163 21 21 PRO CA C 61.7840 . 1 164 21 21 PRO CB C 32.8260 . 1 165 21 21 PRO CD C 50.4290 . 1 166 21 21 PRO CG C 27.5010 . 1 167 22 22 ILE H H 8.9890 . 1 168 22 22 ILE HA H 4.0100 . 1 169 22 22 ILE HB H 1.9690 . 1 170 22 22 ILE HG12 H 1.4640 . 2 171 22 22 ILE HG13 H 1.6140 . 2 172 22 22 ILE HG2 H 0.8500 . 1 173 22 22 ILE C C 173.6300 . 1 174 22 22 ILE CA C 66.1460 . 1 175 22 22 ILE CB C 32.8150 . 1 176 22 22 ILE N N 124.3390 . 1 177 23 23 GLN H H 8.5760 . 1 178 23 23 GLN HA H 3.9830 . 1 179 23 23 GLN HB2 H 1.9750 . 2 180 23 23 GLN HB3 H 2.0390 . 2 181 23 23 GLN HG2 H 2.4280 . 2 182 23 23 GLN HG3 H 2.3300 . 2 183 23 23 GLN C C 176.1030 . 1 184 23 23 GLN CA C 59.7590 . 1 185 23 23 GLN CB C 27.4540 . 1 186 23 23 GLN CG C 33.6120 . 1 187 23 23 GLN N N 120.5060 . 1 188 24 24 LYS H H 7.1170 . 1 189 24 24 LYS HA H 4.1790 . 1 190 24 24 LYS HB2 H 1.9220 . 2 191 24 24 LYS HG2 H 2.1380 . 2 192 24 24 LYS C C 176.7550 . 1 193 24 24 LYS CA C 57.7190 . 1 194 24 24 LYS CB C 32.0790 . 1 195 24 24 LYS CD C 28.5090 . 1 196 24 24 LYS CE C 42.2220 . 1 197 24 24 LYS CG C 24.7310 . 1 198 24 24 LYS N N 117.4960 . 1 199 25 25 VAL H H 7.5890 . 1 200 25 25 VAL HA H 3.2010 . 1 201 25 25 VAL HB H 2.0700 . 1 202 25 25 VAL HG1 H 0.7060 . 2 203 25 25 VAL HG2 H 0.6460 . 2 204 25 25 VAL C C 174.9270 . 1 205 25 25 VAL CA C 67.2000 . 1 206 25 25 VAL CB C 31.0810 . 1 207 25 25 VAL CG1 C 22.9730 . 2 208 25 25 VAL CG2 C 22.3590 . 2 209 25 25 VAL N N 121.2850 . 1 210 26 26 TRP H H 9.5380 . 1 211 26 26 TRP HA H 4.5110 . 1 212 26 26 TRP HB2 H 3.4300 . 2 213 26 26 TRP HB3 H 3.1870 . 2 214 26 26 TRP HD1 H 7.3550 . 1 215 26 26 TRP HE1 H 9.5150 . 1 216 26 26 TRP HE3 H 7.3940 . 1 217 26 26 TRP HH2 H 7.0430 . 1 218 26 26 TRP HZ2 H 7.3710 . 1 219 26 26 TRP HZ3 H 6.5400 . 1 220 26 26 TRP C C 177.8280 . 1 221 26 26 TRP CA C 59.8000 . 1 222 26 26 TRP CB C 29.7470 . 1 223 26 26 TRP CD1 C 122.8090 . 1 224 26 26 TRP CE3 C 120.1810 . 1 225 26 26 TRP CH2 C 125.9340 . 1 226 26 26 TRP CZ2 C 113.7490 . 1 227 26 26 TRP CZ3 C 117.3820 . 1 228 26 26 TRP N N 120.2670 . 1 229 26 26 TRP NE1 N 126.4840 . 1 230 27 27 GLU H H 7.9600 . 1 231 27 27 GLU HA H 3.6620 . 1 232 27 27 GLU HB2 H 2.1610 . 2 233 27 27 GLU HB3 H 2.0450 . 2 234 27 27 GLU HG2 H 2.4140 . 2 235 27 27 GLU HG3 H 2.4010 . 2 236 27 27 GLU C C 174.2790 . 1 237 27 27 GLU CA C 59.9750 . 1 238 27 27 GLU CB C 29.6950 . 1 239 27 27 GLU CG C 36.7720 . 1 240 27 27 GLU N N 120.6730 . 1 241 28 28 THR H H 7.2900 . 1 242 28 28 THR HA H 3.8330 . 1 243 28 28 THR HB H 4.0030 . 1 244 28 28 THR HG2 H 0.9170 . 1 245 28 28 THR C C 171.3080 . 1 246 28 28 THR CA C 66.0140 . 1 247 28 28 THR CB C 68.5620 . 1 248 28 28 THR CG2 C 22.2860 . 1 249 28 28 THR N N 114.0930 . 1 250 29 29 VAL H H 7.3700 . 1 251 29 29 VAL HA H 4.6270 . 1 252 29 29 VAL HB H 2.4640 . 1 253 29 29 VAL HG1 H 0.8280 . 2 254 29 29 VAL HG2 H 0.1390 . 2 255 29 29 VAL C C 169.8910 . 1 256 29 29 VAL CA C 60.2610 . 1 257 29 29 VAL CB C 30.9080 . 1 258 29 29 VAL CG1 C 18.9240 . 2 259 29 29 VAL CG2 C 20.0850 . 2 260 29 29 VAL N N 109.9860 . 1 261 30 30 SER H H 6.9120 . 1 262 30 30 SER HA H 4.0430 . 1 263 30 30 SER HB2 H 3.5520 . 2 264 30 30 SER C C 170.2010 . 1 265 30 30 SER CA C 57.8060 . 1 266 30 30 SER CB C 65.1640 . 1 267 30 30 SER N N 108.5590 . 1 268 31 31 THR H H 6.7540 . 1 269 31 31 THR HA H 4.3660 . 1 270 31 31 THR HB H 4.6740 . 1 271 31 31 THR HG2 H 1.2580 . 1 272 31 31 THR C C 171.1860 . 1 273 31 31 THR CA C 57.9940 . 1 274 31 31 THR CB C 73.0700 . 1 275 31 31 THR CG2 C 21.7370 . 1 276 31 31 THR N N 105.9970 . 1 277 32 32 SER H H 9.2490 . 1 278 32 32 SER HA H 5.4900 . 1 279 32 32 SER HB2 H 3.8920 . 2 280 32 32 SER HB3 H 3.8900 . 2 281 32 32 SER C C 175.7340 . 1 282 32 32 SER CA C 60.4360 . 1 283 32 32 SER CB C 62.9590 . 1 284 32 32 SER N N 118.5490 . 1 285 33 33 GLU H H 9.2530 . 1 286 33 33 GLU HA H 4.1460 . 1 287 33 33 GLU HB2 H 2.0090 . 2 288 33 33 GLU HB3 H 1.9240 . 2 289 33 33 GLU HG2 H 2.2790 . 2 290 33 33 GLU C C 176.0450 . 1 291 33 33 GLU CA C 59.4550 . 1 292 33 33 GLU CB C 29.0590 . 1 293 33 33 GLU CG C 36.6050 . 1 294 33 33 GLU N N 119.0820 . 1 295 34 34 GLY H H 7.5710 . 1 296 34 34 GLY HA2 H 3.8280 . 2 297 34 34 GLY HA3 H 3.7050 . 2 298 34 34 GLY C C 173.0710 . 1 299 34 34 GLY CA C 48.0360 . 1 300 34 34 GLY N N 108.1250 . 1 301 35 35 ILE H H 8.2740 . 1 302 35 35 ILE HA H 3.1410 . 1 303 35 35 ILE HB H 1.2850 . 1 304 35 35 ILE HD1 H -0.5120 . 1 305 35 35 ILE HG12 H 0.4640 . 2 306 35 35 ILE HG13 H 0.4560 . 2 307 35 35 ILE HG2 H 0.5060 . 1 308 35 35 ILE CA C 64.9460 . 1 309 35 35 ILE CB C 38.5200 . 1 310 35 35 ILE CD1 C 11.5700 . 1 311 35 35 ILE CG1 C 31.2680 . 1 312 35 35 ILE CG2 C 18.5220 . 1 313 35 35 ILE N N 120.6180 . 1 314 36 36 ALA H H 7.6780 . 1 315 36 36 ALA HA H 4.1090 . 1 316 36 36 ALA HB H 1.3790 . 1 317 36 36 ALA CA C 54.6240 . 1 318 36 36 ALA CB C 18.3890 . 1 319 36 36 ALA N N 118.7200 . 1 320 41 41 PRO HA H 4.3410 . 1 321 41 41 PRO HB2 H 2.3180 . 2 322 41 41 PRO HB3 H 1.6320 . 2 323 41 41 PRO C C 172.5240 . 1 324 41 41 PRO CA C 63.2650 . 1 325 41 41 PRO CB C 31.4970 . 1 326 41 41 PRO CG C 27.7070 . 1 327 42 42 ASN H H 8.5370 . 1 328 42 42 ASN HA H 5.4140 . 1 329 42 42 ASN HB2 H 2.3430 . 2 330 42 42 ASN HB3 H 2.7860 . 2 331 42 42 ASN C C 169.6000 . 1 332 42 42 ASN CA C 54.7420 . 1 333 42 42 ASN CB C 44.2440 . 1 334 42 42 ASN N N 117.1290 . 1 335 43 43 ASP H H 8.3000 . 1 336 43 43 ASP HA H 4.7950 . 1 337 43 43 ASP HB2 H 2.4120 . 2 338 43 43 ASP HB3 H 2.9810 . 2 339 43 43 ASP C C 172.9030 . 1 340 43 43 ASP CA C 52.2650 . 1 341 43 43 ASP CB C 38.8130 . 1 342 43 43 ASP N N 120.0570 . 1 343 44 44 PHE H H 9.0380 . 1 344 44 44 PHE HA H 2.7490 . 1 345 44 44 PHE HB2 H 2.0550 . 2 346 44 44 PHE HB3 H 1.9240 . 2 347 44 44 PHE HD1 H 7.1410 . 3 348 44 44 PHE HE1 H 6.5920 . 3 349 44 44 PHE C C 171.9090 . 1 350 44 44 PHE CA C 60.9100 . 1 351 44 44 PHE CB C 41.3130 . 1 352 44 44 PHE N N 121.1700 . 1 353 45 45 GLN H H 5.6690 . 1 354 45 45 GLN HA H 4.4140 . 1 355 45 45 GLN HB2 H 2.0940 . 2 356 45 45 GLN HB3 H 2.2100 . 2 357 45 45 GLN HG2 H 2.7140 . 2 358 45 45 GLN C C 171.2300 . 1 359 45 45 GLN CA C 54.5710 . 1 360 45 45 GLN CB C 33.9790 . 1 361 45 45 GLN CG C 40.4020 . 1 362 45 45 GLN N N 122.3500 . 1 363 46 46 LEU H H 8.3210 . 1 364 46 46 LEU HA H 3.7620 . 1 365 46 46 LEU HB2 H 2.1280 . 2 366 46 46 LEU HB3 H 1.5890 . 2 367 46 46 LEU HG H 1.6400 . 1 368 46 46 LEU C C 171.7390 . 1 369 46 46 LEU CA C 53.5690 . 1 370 46 46 LEU CB C 40.3940 . 1 371 46 46 LEU CG C 25.8070 . 1 372 46 46 LEU N N 123.9960 . 1 373 47 47 LYS H H 7.3410 . 1 374 47 47 LYS HA H 4.3200 . 1 375 47 47 LYS HB2 H 1.5480 . 2 376 47 47 LYS HB3 H 1.4300 . 2 377 47 47 LYS HG2 H 1.2640 . 2 378 47 47 LYS C C 172.1810 . 1 379 47 47 LYS CA C 55.6140 . 1 380 47 47 LYS CB C 35.1530 . 1 381 47 47 LYS CD C 29.1010 . 1 382 47 47 LYS CE C 42.1920 . 1 383 47 47 LYS CG C 24.6400 . 1 384 47 47 LYS N N 128.4990 . 1 385 48 48 GLU H H 9.1270 . 1 386 48 48 GLU HA H 3.5050 . 1 387 48 48 GLU HB2 H 1.9460 . 2 388 48 48 GLU HB3 H 1.9000 . 2 389 48 48 GLU HG2 H 2.3690 . 2 390 48 48 GLU HG3 H 2.0970 . 2 391 48 48 GLU C C 174.4090 . 1 392 48 48 GLU CA C 59.6500 . 1 393 48 48 GLU CB C 29.1460 . 1 394 48 48 GLU CG C 37.4910 . 1 395 48 48 GLU N N 126.6230 . 1 396 49 49 GLY H H 8.4370 . 1 397 49 49 GLY HA2 H 4.2420 . 2 398 49 49 GLY HA3 H 3.6830 . 2 399 49 49 GLY C C 174.2200 . 1 400 49 49 GLY CA C 45.5240 . 1 401 49 49 GLY N N 113.0430 . 1 402 50 50 GLN H H 7.8270 . 1 403 50 50 GLN HA H 4.1620 . 1 404 50 50 GLN HB2 H 1.9110 . 2 405 50 50 GLN HB3 H 2.0030 . 2 406 50 50 GLN HG2 H 2.2050 . 2 407 50 50 GLN HG3 H 2.2990 . 2 408 50 50 GLN C C 173.5240 . 1 409 50 50 GLN CA C 57.3050 . 1 410 50 50 GLN CB C 30.0290 . 1 411 50 50 GLN CG C 36.2660 . 1 412 50 50 GLN N N 121.8850 . 1 413 51 51 GLU H H 9.0620 . 1 414 51 51 GLU HA H 4.4780 . 1 415 51 51 GLU HB2 H 1.7550 . 2 416 51 51 GLU HG2 H 2.0990 . 2 417 51 51 GLU HG3 H 1.7570 . 2 418 51 51 GLU C C 172.6680 . 1 419 51 51 GLU CA C 55.5710 . 1 420 51 51 GLU CB C 33.6790 . 1 421 51 51 GLU N N 121.9740 . 1 422 52 52 PHE H H 8.8800 . 1 423 52 52 PHE HA H 5.0510 . 1 424 52 52 PHE HB2 H 3.0800 . 2 425 52 52 PHE HB3 H 2.8990 . 2 426 52 52 PHE CA C 56.8060 . 1 427 52 52 PHE N N 120.7920 . 1 428 58 58 PHE C C 173.5320 . 1 429 58 58 PHE CA C 60.0340 . 1 430 58 58 PHE CB C 40.8120 . 1 431 59 59 GLY H H 9.3030 . 1 432 59 59 GLY HA2 H 3.6480 . 2 433 59 59 GLY HA3 H 3.9570 . 2 434 59 59 GLY CA C 45.5460 . 1 435 59 59 GLY N N 113.4800 . 1 436 62 62 PRO HA H 4.0380 . 1 437 62 62 PRO HB2 H 1.9450 . 2 438 62 62 PRO HB3 H 1.9870 . 2 439 62 62 PRO HG2 H 2.2960 . 2 440 62 62 PRO CA C 63.1260 . 1 441 62 62 PRO CB C 29.5940 . 1 442 62 62 PRO CG C 33.8140 . 1 443 63 63 CYS H H 8.5170 . 1 444 63 63 CYS HA H 5.0540 . 1 445 63 63 CYS HB2 H 2.1420 . 2 446 63 63 CYS HB3 H 0.3610 . 2 447 63 63 CYS C C 171.9500 . 1 448 63 63 CYS CA C 57.5520 . 1 449 63 63 CYS CB C 33.3990 . 1 450 63 63 CYS N N 120.1540 . 1 451 64 64 LYS H H 7.9680 . 1 452 64 64 LYS HA H 5.0660 . 1 453 64 64 LYS HB2 H 1.6420 . 2 454 64 64 LYS C C 173.2860 . 1 455 64 64 LYS CA C 56.1790 . 1 456 64 64 LYS CB C 36.2790 . 1 457 64 64 LYS CD C 29.3140 . 1 458 64 64 LYS CE C 41.5430 . 1 459 64 64 LYS CG C 24.1960 . 1 460 64 64 LYS N N 119.7140 . 1 461 65 65 VAL H H 8.6140 . 1 462 65 65 VAL HA H 3.9870 . 1 463 65 65 VAL HB H 2.5180 . 1 464 65 65 VAL HG1 H 1.0570 . 2 465 65 65 VAL HG2 H 0.8800 . 2 466 65 65 VAL C C 173.3920 . 1 467 65 65 VAL CA C 65.5720 . 1 468 65 65 VAL CB C 31.6400 . 1 469 65 65 VAL CG1 C 24.6700 . 2 470 65 65 VAL CG2 C 22.9310 . 2 471 65 65 VAL N N 127.9660 . 1 472 66 66 LEU H H 9.3460 . 1 473 66 66 LEU HA H 4.3040 . 1 474 66 66 LEU HB2 H 1.4600 . 2 475 66 66 LEU HB3 H 1.6140 . 2 476 66 66 LEU HD1 H 0.8350 . 2 477 66 66 LEU C C 173.6530 . 1 478 66 66 LEU CA C 55.6140 . 1 479 66 66 LEU CB C 43.7900 . 1 480 66 66 LEU CD1 C 22.1530 . 2 481 66 66 LEU CG C 26.2680 . 1 482 66 66 LEU N N 131.0820 . 1 483 67 67 ALA H H 7.5650 . 1 484 67 67 ALA HA H 4.7540 . 1 485 67 67 ALA HB H 1.2970 . 1 486 67 67 ALA C C 172.7240 . 1 487 67 67 ALA CA C 51.9820 . 1 488 67 67 ALA CB C 22.0530 . 1 489 67 67 ALA N N 120.2350 . 1 490 68 68 VAL H H 9.1350 . 1 491 68 68 VAL HA H 4.4700 . 1 492 68 68 VAL HB H 2.1110 . 1 493 68 68 VAL HG1 H 1.2170 . 2 494 68 68 VAL HG2 H 0.9100 . 2 495 68 68 VAL C C 172.1780 . 1 496 68 68 VAL CA C 62.3210 . 1 497 68 68 VAL CB C 35.7200 . 1 498 68 68 VAL CG1 C 21.4560 . 2 499 68 68 VAL CG2 C 21.5330 . 2 500 68 68 VAL N N 120.6380 . 1 501 69 69 GLN H H 9.1520 . 1 502 69 69 GLN HA H 4.5530 . 1 503 69 69 GLN HB2 H 1.8780 . 2 504 69 69 GLN HB3 H 2.0000 . 2 505 69 69 GLN HG2 H 2.1160 . 2 506 69 69 GLN C C 170.9940 . 1 507 69 69 GLN CA C 54.0970 . 1 508 69 69 GLN CB C 29.5900 . 1 509 69 69 GLN CG C 35.2400 . 1 510 69 69 GLN N N 129.5380 . 1 511 70 70 ALA H H 8.8830 . 1 512 70 70 ALA HA H 4.5840 . 1 513 70 70 ALA HB H 1.1000 . 1 514 70 70 ALA CA C 50.9160 . 1 515 70 70 ALA CB C 18.1710 . 1 516 70 70 ALA N N 129.0530 . 1 517 71 71 PRO HB2 H 1.9780 . 2 518 71 71 PRO C C 168.3520 . 1 519 71 71 PRO CA C 63.5610 . 1 520 71 71 PRO CB C 30.7230 . 1 521 72 72 THR H H 7.7230 . 1 522 72 72 THR HA H 4.5730 . 1 523 72 72 THR HB H 4.3570 . 1 524 72 72 THR HG2 H 0.9460 . 1 525 72 72 THR C C 173.5420 . 1 526 72 72 THR CA C 62.8220 . 1 527 72 72 THR CB C 71.0200 . 1 528 72 72 THR CG2 C 22.1510 . 1 529 72 72 THR N N 105.0580 . 1 530 73 73 GLU H H 8.3490 . 1 531 73 73 GLU HA H 5.5910 . 1 532 73 73 GLU HB2 H 2.1200 . 2 533 73 73 GLU HB3 H 1.8300 . 2 534 73 73 GLU HG2 H 2.2410 . 2 535 73 73 GLU HG3 H 2.1210 . 2 536 73 73 GLU C C 171.4200 . 1 537 73 73 GLU CA C 56.9990 . 1 538 73 73 GLU CB C 34.1280 . 1 539 73 73 GLU CG C 32.2450 . 1 540 73 73 GLU N N 124.7620 . 1 541 74 74 LEU H H 8.6010 . 1 542 74 74 LEU HA H 5.2320 . 1 543 74 74 LEU HB2 H 2.0140 . 2 544 74 74 LEU HB3 H 1.9560 . 2 545 74 74 LEU HD1 H 0.7840 . 2 546 74 74 LEU HD2 H 0.9900 . 2 547 74 74 LEU HG H 1.6750 . 1 548 74 74 LEU C C 171.6390 . 1 549 74 74 LEU CA C 54.7700 . 1 550 74 74 LEU CB C 47.1580 . 1 551 74 74 LEU CD1 C 26.5730 . 2 552 74 74 LEU CD2 C 25.4540 . 2 553 74 74 LEU CG C 27.7160 . 1 554 74 74 LEU N N 125.9080 . 1 555 75 75 SER H H 8.8550 . 1 556 75 75 SER HA H 5.8240 . 1 557 75 75 SER HB2 H 3.6760 . 2 558 75 75 SER HB3 H 3.5870 . 2 559 75 75 SER C C 171.9200 . 1 560 75 75 SER CA C 56.3990 . 1 561 75 75 SER CB C 67.0650 . 1 562 75 75 SER N N 116.5190 . 1 563 76 76 PHE H H 9.3050 . 1 564 76 76 PHE HA H 5.4910 . 1 565 76 76 PHE HB2 H 3.2050 . 2 566 76 76 PHE HB3 H 3.0690 . 2 567 76 76 PHE HD1 H 6.8000 . 3 568 76 76 PHE HE1 H 6.6470 . 3 569 76 76 PHE C C 169.8590 . 1 570 76 76 PHE CA C 55.8890 . 1 571 76 76 PHE CB C 42.7870 . 1 572 76 76 PHE CD1 C 133.0770 . 2 573 76 76 PHE CE1 C 128.4710 . 2 574 76 76 PHE N N 119.4030 . 1 575 77 77 GLU H H 9.2660 . 1 576 77 77 GLU HA H 4.8140 . 1 577 77 77 GLU HB2 H 2.1850 . 2 578 77 77 GLU HB3 H 2.1350 . 2 579 77 77 GLU HG2 H 2.3990 . 2 580 77 77 GLU HG3 H 2.3270 . 2 581 77 77 GLU C C 171.8170 . 1 582 77 77 GLU CA C 55.8360 . 1 583 77 77 GLU CB C 32.0510 . 1 584 77 77 GLU CG C 32.0300 . 1 585 77 77 GLU N N 121.3760 . 1 586 78 78 TRP H H 7.9180 . 1 587 78 78 TRP HA H 4.2460 . 1 588 78 78 TRP HB2 H 2.3870 . 2 589 78 78 TRP HB3 H 2.2110 . 2 590 78 78 TRP HD1 H 6.0350 . 1 591 78 78 TRP C C 175.1330 . 1 592 78 78 TRP CA C 56.3850 . 1 593 78 78 TRP CB C 29.7410 . 1 594 78 78 TRP CD1 C 124.4750 . 1 595 78 78 TRP N N 118.8930 . 1 596 79 79 ASP H H 8.8340 . 1 597 79 79 ASP HA H 4.5400 . 1 598 79 79 ASP HB2 H 3.0180 . 2 599 79 79 ASP HB3 H 2.2670 . 2 600 79 79 ASP C C 175.2410 . 1 601 79 79 ASP CA C 55.1130 . 1 602 79 79 ASP CB C 42.7660 . 1 603 79 79 ASP N N 128.0990 . 1 604 80 80 THR H H 9.6710 . 1 605 80 80 THR HA H 4.4270 . 1 606 80 80 THR HB H 3.3990 . 1 607 80 80 THR HG2 H 1.6270 . 1 608 80 80 THR C C 172.9370 . 1 609 80 80 THR CA C 62.6910 . 1 610 80 80 THR CB C 69.1170 . 1 611 80 80 THR CG2 C 21.0180 . 1 612 80 80 THR N N 109.8030 . 1 613 81 81 GLU H H 8.2570 . 1 614 81 81 GLU HA H 4.1000 . 1 615 81 81 GLU HB2 H 2.0220 . 2 616 81 81 GLU HB3 H 1.9060 . 2 617 81 81 GLU HG2 H 2.3850 . 2 618 81 81 GLU HG3 H 2.2090 . 2 619 81 81 GLU C C 173.3000 . 1 620 81 81 GLU CA C 55.8010 . 1 621 81 81 GLU CB C 30.0290 . 1 622 81 81 GLU CG C 36.9740 . 1 623 81 81 GLU N N 120.5290 . 1 624 82 82 GLY H H 7.7370 . 1 625 82 82 GLY HA2 H 4.4190 . 2 626 82 82 GLY HA3 H 3.4070 . 2 627 82 82 GLY C C 175.0650 . 1 628 82 82 GLY CA C 45.1080 . 1 629 82 82 GLY N N 107.3790 . 1 630 83 83 TRP H H 7.9240 . 1 631 83 83 TRP HA H 4.4410 . 1 632 83 83 TRP HB2 H 2.8480 . 2 633 83 83 TRP HB3 H 2.5810 . 2 634 83 83 TRP HH2 H 7.3300 . 1 635 83 83 TRP HZ2 H 7.6860 . 1 636 83 83 TRP CA C 58.3690 . 1 637 83 83 TRP CB C 30.4690 . 1 638 83 83 TRP N N 118.7930 . 1 639 84 84 VAL H H 8.8280 . 1 640 84 84 VAL HA H 4.4750 . 1 641 84 84 VAL HB H 2.1200 . 1 642 84 84 VAL HG1 H 0.9080 . 2 643 84 84 VAL HG2 H 1.2160 . 2 644 84 84 VAL C C 171.1010 . 1 645 84 84 VAL CA C 62.2800 . 1 646 84 84 VAL CB C 35.8590 . 1 647 84 84 VAL CG1 C 21.4800 . 2 648 84 84 VAL CG2 C 21.4710 . 2 649 84 84 VAL N N 129.4810 . 1 650 85 85 VAL H H 8.7960 . 1 651 85 85 VAL HA H 4.2380 . 1 652 85 85 VAL HB H 1.7600 . 1 653 85 85 VAL HG1 H 0.6890 . 2 654 85 85 VAL HG2 H 0.8420 . 2 655 85 85 VAL C C 174.6110 . 1 656 85 85 VAL CA C 62.7580 . 1 657 85 85 VAL CB C 32.7610 . 1 658 85 85 VAL CG1 C 21.2380 . 2 659 85 85 VAL CG2 C 20.9840 . 2 660 85 85 VAL N N 128.8110 . 1 661 86 86 THR H H 7.8650 . 1 662 86 86 THR HA H 4.9090 . 1 663 86 86 THR HB H 3.6900 . 1 664 86 86 THR HG2 H 1.0320 . 1 665 86 86 THR C C 169.9420 . 1 666 86 86 THR CA C 61.0690 . 1 667 86 86 THR CB C 71.6100 . 1 668 86 86 THR CG2 C 21.1880 . 1 669 86 86 THR N N 118.2730 . 1 670 87 87 PHE H H 9.1270 . 1 671 87 87 PHE HA H 5.2930 . 1 672 87 87 PHE HB2 H 3.1300 . 2 673 87 87 PHE HB3 H 3.0690 . 2 674 87 87 PHE HD1 H 7.0570 . 3 675 87 87 PHE HE1 H 7.3300 . 3 676 87 87 PHE C C 172.0540 . 1 677 87 87 PHE CA C 52.0440 . 1 678 87 87 PHE CB C 40.2490 . 1 679 87 87 PHE CD1 C 130.6680 . 2 680 87 87 PHE CE1 C 131.0350 . 2 681 87 87 PHE N N 124.5890 . 1 682 88 88 GLN H H 8.8000 . 1 683 88 88 GLN HA H 5.2610 . 1 684 88 88 GLN HB2 H 1.8370 . 2 685 88 88 GLN HB3 H 1.7170 . 2 686 88 88 GLN HG2 H 2.1550 . 2 687 88 88 GLN HG3 H 1.9970 . 2 688 88 88 GLN C C 172.1800 . 1 689 88 88 GLN CA C 54.3080 . 1 690 88 88 GLN CB C 31.5050 . 1 691 88 88 GLN CG C 34.0950 . 1 692 88 88 GLN N N 120.2060 . 1 693 89 89 LEU H H 9.4180 . 1 694 89 89 LEU HA H 4.5780 . 1 695 89 89 LEU HB2 H 1.6110 . 2 696 89 89 LEU HB3 H 1.4710 . 2 697 89 89 LEU CA C 55.4260 . 1 698 89 89 LEU CB C 44.5220 . 1 699 89 89 LEU CD1 C 21.8480 . 2 700 89 89 LEU CG C 28.4790 . 1 701 89 89 LEU N N 126.9400 . 1 702 90 90 GLU H H 9.1190 . 1 703 90 90 GLU HA H 4.4800 . 1 704 90 90 GLU HB2 H 1.6500 . 2 705 90 90 GLU HB3 H 1.4860 . 2 706 90 90 GLU HG2 H 1.9310 . 2 707 90 90 GLU HG3 H 2.0830 . 2 708 90 90 GLU C C 172.5280 . 1 709 90 90 GLU CA C 54.1780 . 1 710 90 90 GLU CB C 33.3910 . 1 711 90 90 GLU CG C 35.9260 . 1 712 90 90 GLU N N 121.2320 . 1 713 91 91 ASP H H 8.9030 . 1 714 91 91 ASP HA H 4.5090 . 1 715 91 91 ASP HB2 H 2.9820 . 2 716 91 91 ASP HB3 H 2.4780 . 2 717 91 91 ASP C C 173.0020 . 1 718 91 91 ASP CA C 54.6740 . 1 719 91 91 ASP CB C 40.7160 . 1 720 91 91 ASP N N 126.4390 . 1 721 92 92 LEU H H 7.7600 . 1 722 92 92 LEU HA H 4.7040 . 1 723 92 92 LEU HB2 H 1.5610 . 2 724 92 92 LEU HB3 H 1.3020 . 2 725 92 92 LEU HG H 0.7090 . 1 726 92 92 LEU C C 175.4670 . 1 727 92 92 LEU CA C 53.2340 . 1 728 92 92 LEU CB C 41.5950 . 1 729 92 92 LEU CD1 C 22.2350 . 2 730 92 92 LEU CG C 25.9830 . 1 731 92 92 LEU N N 130.4250 . 1 732 93 93 GLY H H 8.8670 . 1 733 93 93 GLY HA2 H 3.5330 . 2 734 93 93 GLY HA3 H 4.1920 . 2 735 93 93 GLY C C 171.4100 . 1 736 93 93 GLY CA C 47.2800 . 1 737 93 93 GLY N N 110.9920 . 1 738 94 94 GLU H H 8.7780 . 1 739 94 94 GLU HA H 4.0620 . 1 740 94 94 GLU HB2 H 2.0830 . 2 741 94 94 GLU HB3 H 1.8370 . 2 742 94 94 GLU HG2 H 2.1900 . 2 743 94 94 GLU HG3 H 2.2790 . 2 744 94 94 GLU C C 171.6690 . 1 745 94 94 GLU CA C 56.9400 . 1 746 94 94 GLU CB C 29.4440 . 1 747 94 94 GLU CG C 35.1610 . 1 748 94 94 GLU N N 126.8070 . 1 749 95 95 LYS H H 6.9590 . 1 750 95 95 LYS HA H 4.8130 . 1 751 95 95 LYS HB2 H 1.1850 . 2 752 95 95 LYS HD2 H 1.6480 . 2 753 95 95 LYS HE2 H 2.8480 . 2 754 95 95 LYS HG2 H 1.4670 . 2 755 95 95 LYS C C 172.6920 . 1 756 95 95 LYS CA C 54.4100 . 1 757 95 95 LYS CB C 36.1060 . 1 758 95 95 LYS CD C 29.6680 . 1 759 95 95 LYS CE C 41.7790 . 1 760 95 95 LYS CG C 25.2640 . 1 761 95 95 LYS N N 115.2980 . 1 762 96 96 THR H H 8.7940 . 1 763 96 96 THR HA H 4.9340 . 1 764 96 96 THR HB H 3.6440 . 1 765 96 96 THR HG2 H 1.1130 . 1 766 96 96 THR C C 171.7370 . 1 767 96 96 THR CA C 62.4630 . 1 768 96 96 THR CB C 72.6720 . 1 769 96 96 THR CG2 C 21.0490 . 1 770 96 96 THR N N 116.1050 . 1 771 97 97 GLY H H 9.5140 . 1 772 97 97 GLY HA2 H 4.5100 . 2 773 97 97 GLY HA3 H 3.7370 . 2 774 97 97 GLY C C 169.1040 . 1 775 97 97 GLY CA C 45.5470 . 1 776 97 97 GLY N N 115.5300 . 1 777 98 98 PHE H H 9.1420 . 1 778 98 98 PHE HA H 5.2560 . 1 779 98 98 PHE HB2 H 2.9150 . 2 780 98 98 PHE HB3 H 2.3580 . 2 781 98 98 PHE HD1 H 6.5600 . 3 782 98 98 PHE HE1 H 6.6510 . 3 783 98 98 PHE HZ H 6.1700 . 1 784 98 98 PHE C C 170.8050 . 1 785 98 98 PHE CA C 57.4300 . 1 786 98 98 PHE CB C 43.0590 . 1 787 98 98 PHE CD1 C 130.6650 . 2 788 98 98 PHE CE1 C 130.6990 . 2 789 98 98 PHE CZ C 126.9840 . 1 790 98 98 PHE N N 129.0750 . 1 791 99 99 THR H H 8.5190 . 1 792 99 99 THR HA H 4.9070 . 1 793 99 99 THR HB H 3.6780 . 1 794 99 99 THR HG2 H 0.8940 . 1 795 99 99 THR C C 173.4860 . 1 796 99 99 THR CA C 61.5640 . 1 797 99 99 THR CB C 71.6060 . 1 798 99 99 THR CG2 C 21.0250 . 1 799 99 99 THR N N 125.7920 . 1 800 100 100 LEU H H 8.8260 . 1 801 100 100 LEU HA H 4.8810 . 1 802 100 100 LEU HB2 H 1.4590 . 2 803 100 100 LEU HB3 H 1.3960 . 2 804 100 100 LEU HD1 H -0.0800 . 2 805 100 100 LEU HD2 H -0.1130 . 2 806 100 100 LEU HG H 1.0640 . 1 807 100 100 LEU C C 172.6010 . 1 808 100 100 LEU CA C 52.1350 . 1 809 100 100 LEU CB C 45.3510 . 1 810 100 100 LEU CD1 C 25.0040 . 2 811 100 100 LEU CD2 C 23.2080 . 2 812 100 100 LEU CG C 27.5360 . 1 813 100 100 LEU N N 129.2560 . 1 814 101 101 ILE H H 8.9050 . 1 815 101 101 ILE HA H 4.9060 . 1 816 101 101 ILE HB H 1.5420 . 1 817 101 101 ILE HD1 H 0.6140 . 1 818 101 101 ILE HG12 H 1.2320 . 2 819 101 101 ILE HG13 H 0.9060 . 2 820 101 101 ILE HG2 H 0.7670 . 1 821 101 101 ILE C C 172.6820 . 1 822 101 101 ILE CA C 60.4990 . 1 823 101 101 ILE CB C 41.4610 . 1 824 101 101 ILE CD1 C 14.7990 . 1 825 101 101 ILE CG1 C 28.0020 . 1 826 101 101 ILE CG2 C 19.5870 . 1 827 101 101 ILE N N 124.4900 . 1 828 102 102 HIS H H 9.5760 . 1 829 102 102 HIS HA H 5.5760 . 1 830 102 102 HIS HB2 H 3.3620 . 2 831 102 102 HIS HB3 H 2.5990 . 2 832 102 102 HIS HD1 H 11.1820 . 1 833 102 102 HIS HD2 H 7.1390 . 1 834 102 102 HIS C C 173.0240 . 1 835 102 102 HIS CA C 53.4220 . 1 836 102 102 HIS CB C 32.8110 . 1 837 102 102 HIS CD2 C 124.2210 . 1 838 102 102 HIS N N 131.4500 . 1 839 102 102 HIS ND1 N 119.4470 . 1 840 103 103 SER H H 9.7770 . 1 841 103 103 SER HA H 5.1480 . 1 842 103 103 SER HB2 H 4.0220 . 2 843 103 103 SER HB3 H 3.5060 . 2 844 103 103 SER C C 171.9230 . 1 845 103 103 SER CA C 56.4280 . 1 846 103 103 SER CB C 66.4090 . 1 847 103 103 SER N N 125.5520 . 1 848 104 104 GLY H H 8.3260 . 1 849 104 104 GLY HA2 H 3.9530 . 2 850 104 104 GLY HA3 H 3.6440 . 2 851 104 104 GLY C C 173.2870 . 1 852 104 104 GLY CA C 45.6940 . 1 853 104 104 GLY N N 105.9240 . 1 854 105 105 TRP H H 8.4680 . 1 855 105 105 TRP CA C 57.8540 . 1 856 105 105 TRP CB C 32.3440 . 1 857 105 105 TRP N N 118.8270 . 1 858 110 110 GLN H H 8.8160 . 1 859 110 110 GLN HA H 4.5120 . 1 860 110 110 GLN HB2 H 1.7140 . 2 861 110 110 GLN HG2 H 2.2160 . 2 862 110 110 GLN C C 173.0720 . 1 863 110 110 GLN CA C 61.7510 . 1 864 110 110 GLN CB C 33.4040 . 1 865 110 110 GLN CG C 35.7640 . 1 866 110 110 GLN N N 128.5310 . 1 867 111 111 VAL H H 8.5410 . 1 868 111 111 VAL HA H 4.4000 . 1 869 111 111 VAL HB H 1.7080 . 1 870 111 111 VAL HG1 H 0.7060 . 2 871 111 111 VAL HG2 H 1.0940 . 2 872 111 111 VAL C C 170.7070 . 1 873 111 111 VAL CA C 59.9570 . 1 874 111 111 VAL CB C 40.9790 . 1 875 111 111 VAL CG1 C 17.8770 . 2 876 111 111 VAL CG2 C 20.7180 . 2 877 111 111 VAL N N 122.8490 . 1 878 112 112 ILE H H 7.4070 . 1 879 112 112 ILE HA H 4.0370 . 1 880 112 112 ILE HB H 1.8050 . 1 881 112 112 ILE HD1 H 0.6140 . 1 882 112 112 ILE HG12 H 1.5380 . 2 883 112 112 ILE HG13 H 0.9590 . 2 884 112 112 ILE HG2 H 0.8680 . 1 885 112 112 ILE CA C 66.1480 . 1 886 112 112 ILE CB C 37.9270 . 1 887 112 112 ILE CD1 C 14.7560 . 1 888 112 112 ILE CG1 C 30.3430 . 1 889 112 112 ILE CG2 C 15.6290 . 1 890 112 112 ILE N N 122.5420 . 1 891 114 114 LYS C C 170.6040 . 1 892 115 115 ALA H H 6.3250 . 1 893 115 115 ALA HA H 3.5830 . 1 894 115 115 ALA HB H 1.2690 . 1 895 115 115 ALA CA C 53.3300 . 1 896 115 115 ALA CB C 18.4050 . 1 897 115 115 ALA N N 117.5920 . 1 898 118 118 LYS HA H 3.9960 . 1 899 118 118 LYS HB2 H 1.6790 . 2 900 118 118 LYS HB3 H 1.5300 . 2 901 118 118 LYS HD2 H 1.8670 . 2 902 118 118 LYS HD3 H 1.7800 . 2 903 118 118 LYS HG2 H 1.3640 . 2 904 118 118 LYS HG3 H 1.2910 . 2 905 118 118 LYS C C 175.7220 . 1 906 118 118 LYS CA C 57.8050 . 1 907 118 118 LYS CB C 32.3380 . 1 908 118 118 LYS CG C 24.9200 . 1 909 119 119 SER H H 8.7320 . 1 910 119 119 SER HA H 4.2380 . 1 911 119 119 SER HB2 H 3.8500 . 2 912 119 119 SER C C 172.6950 . 1 913 119 119 SER CA C 64.3750 . 1 914 119 119 SER CB C 64.1830 . 1 915 119 119 SER N N 120.5680 . 1 916 120 120 SER H H 9.1040 . 1 917 120 120 SER HA H 3.7720 . 1 918 120 120 SER HB2 H 3.8550 . 2 919 120 120 SER C C 174.0120 . 1 920 120 120 SER CA C 61.4500 . 1 921 120 120 SER N N 114.2250 . 1 922 121 121 VAL H H 6.9830 . 1 923 121 121 VAL HA H 3.7310 . 1 924 121 121 VAL HB H 2.3420 . 1 925 121 121 VAL HG1 H 1.0440 . 2 926 121 121 VAL HG2 H 0.9330 . 2 927 121 121 VAL C C 176.3050 . 1 928 121 121 VAL CA C 65.3840 . 1 929 121 121 VAL CB C 31.9320 . 1 930 121 121 VAL CG1 C 22.4910 . 2 931 121 121 VAL CG2 C 20.6280 . 2 932 121 121 VAL N N 125.6920 . 1 933 122 122 VAL H H 7.9610 . 1 934 122 122 VAL HA H 3.5650 . 1 935 122 122 VAL HB H 2.2400 . 1 936 122 122 VAL HG1 H 1.3670 . 2 937 122 122 VAL HG2 H 1.0350 . 2 938 122 122 VAL C C 175.1610 . 1 939 122 122 VAL CA C 66.8250 . 1 940 122 122 VAL CB C 32.4920 . 1 941 122 122 VAL CG1 C 22.3750 . 2 942 122 122 VAL CG2 C 23.3290 . 2 943 122 122 VAL N N 121.7080 . 1 944 123 123 ARG H H 8.8970 . 1 945 123 123 ARG HA H 4.1370 . 1 946 123 123 ARG HB2 H 2.1290 . 2 947 123 123 ARG HB3 H 2.0330 . 2 948 123 123 ARG C C 175.5700 . 1 949 123 123 ARG CA C 59.9170 . 1 950 123 123 ARG CB C 28.5310 . 1 951 123 123 ARG CD C 41.7110 . 1 952 123 123 ARG N N 120.4900 . 1 953 124 124 GLY H H 7.4200 . 1 954 124 124 GLY HA2 H 3.8490 . 2 955 124 124 GLY C C 174.3320 . 1 956 124 124 GLY CA C 47.5970 . 1 957 124 124 GLY N N 104.5070 . 1 958 125 125 LYS H H 7.6230 . 1 959 125 125 LYS HA H 4.1350 . 1 960 125 125 LYS HB2 H 2.0090 . 2 961 125 125 LYS HB3 H 1.9240 . 2 962 125 125 LYS HD2 H 1.7070 . 2 963 125 125 LYS HE2 H 2.9810 . 2 964 125 125 LYS HE3 H 2.8720 . 2 965 125 125 LYS HG2 H 1.4650 . 2 966 125 125 LYS HG3 H 1.6140 . 2 967 125 125 LYS C C 177.6710 . 1 968 125 125 LYS CA C 59.6220 . 1 969 125 125 LYS CB C 32.6640 . 1 970 125 125 LYS CD C 29.7370 . 1 971 125 125 LYS CE C 38.6300 . 1 972 125 125 LYS CG C 25.7790 . 1 973 125 125 LYS N N 122.0540 . 1 974 126 126 MET H H 8.6900 . 1 975 126 126 MET HA H 4.4050 . 1 976 126 126 MET HB2 H 2.0610 . 2 977 126 126 MET HG2 H 2.7350 . 2 978 126 126 MET HG3 H 2.5650 . 2 979 126 126 MET C C 174.8820 . 1 980 126 126 MET CA C 57.6350 . 1 981 126 126 MET CB C 31.3430 . 1 982 126 126 MET CG C 33.2140 . 1 983 126 126 MET N N 119.5380 . 1 984 127 127 ASP H H 8.9210 . 1 985 127 127 ASP HA H 4.4420 . 1 986 127 127 ASP HB2 H 2.5790 . 2 987 127 127 ASP HB3 H 2.8640 . 2 988 127 127 ASP C C 175.9410 . 1 989 127 127 ASP CA C 55.0500 . 1 990 127 127 ASP CB C 41.7410 . 1 991 127 127 ASP N N 122.9410 . 1 992 128 128 GLY H H 7.4840 . 1 993 128 128 GLY HA2 H 4.0280 . 2 994 128 128 GLY HA3 H 4.6220 . 2 995 128 128 GLY C C 175.0640 . 1 996 128 128 GLY CA C 47.4540 . 1 997 128 128 GLY N N 104.0820 . 1 998 129 129 GLY H H 8.3950 . 1 999 129 129 GLY HA2 H 3.9640 . 2 1000 129 129 GLY C C 174.5620 . 1 1001 129 129 GLY CA C 47.3210 . 1 1002 129 129 GLY N N 110.3740 . 1 1003 130 130 TRP H H 9.4220 . 1 1004 130 130 TRP HA H 5.0080 . 1 1005 130 130 TRP HB2 H 3.4390 . 2 1006 130 130 TRP HB3 H 3.2440 . 2 1007 130 130 TRP HD1 H 7.1550 . 1 1008 130 130 TRP HE1 H 10.1710 . 1 1009 130 130 TRP HE3 H 7.3450 . 1 1010 130 130 TRP HH2 H 7.1320 . 1 1011 130 130 TRP HZ2 H 7.2750 . 1 1012 130 130 TRP HZ3 H 6.5240 . 1 1013 130 130 TRP C C 175.9430 . 1 1014 130 130 TRP CA C 60.3110 . 1 1015 130 130 TRP CB C 31.4280 . 1 1016 130 130 TRP CD1 C 127.7850 . 1 1017 130 130 TRP CE3 C 122.9360 . 1 1018 130 130 TRP CH2 C 124.2210 . 1 1019 130 130 TRP CZ2 C 112.9160 . 1 1020 130 130 TRP CZ3 C 120.0360 . 1 1021 130 130 TRP N N 121.6500 . 1 1022 130 130 TRP NE1 N 130.0750 . 1 1023 131 131 THR H H 7.9560 . 1 1024 131 131 THR HA H 4.8970 . 1 1025 131 131 THR HB H 3.9010 . 1 1026 131 131 THR HG2 H 0.9710 . 1 1027 131 131 THR C C 173.2010 . 1 1028 131 131 THR CA C 68.3900 . 1 1029 131 131 THR CB C 68.9710 . 1 1030 131 131 THR CG2 C 22.5240 . 1 1031 131 131 THR N N 115.8570 . 1 1032 132 132 GLY H H 7.5150 . 1 1033 132 132 GLY HA2 H 4.2260 . 2 1034 132 132 GLY HA3 H 4.0600 . 2 1035 132 132 GLY C C 173.8760 . 1 1036 132 132 GLY CA C 47.4500 . 1 1037 132 132 GLY N N 106.7210 . 1 1038 133 133 ILE H H 8.1350 . 1 1039 133 133 ILE HA H 4.3220 . 1 1040 133 133 ILE HB H 1.7740 . 1 1041 133 133 ILE C C 174.0150 . 1 1042 133 133 ILE CA C 66.3700 . 1 1043 133 133 ILE CB C 41.7410 . 1 1044 133 133 ILE N N 123.4510 . 1 1045 134 134 VAL H H 8.5880 . 1 1046 134 134 VAL HA H 3.6280 . 1 1047 134 134 VAL HB H 2.0850 . 1 1048 134 134 VAL HG1 H 1.1530 . 2 1049 134 134 VAL HG2 H 0.7910 . 2 1050 134 134 VAL C C 172.7820 . 1 1051 134 134 VAL CA C 66.0730 . 1 1052 134 134 VAL CB C 32.1210 . 1 1053 134 134 VAL CG1 C 23.4510 . 2 1054 134 134 VAL CG2 C 21.9400 . 2 1055 134 134 VAL N N 116.2910 . 1 1056 135 135 ASN H H 8.1150 . 1 1057 135 135 ASN HA H 4.4030 . 1 1058 135 135 ASN HB2 H 3.0730 . 2 1059 135 135 ASN HB3 H 2.7480 . 2 1060 135 135 ASN C C 173.3180 . 1 1061 135 135 ASN CA C 55.7590 . 1 1062 135 135 ASN CB C 38.8920 . 1 1063 135 135 ASN N N 111.8240 . 1 1064 136 136 GLU H H 7.8160 . 1 1065 136 136 GLU HA H 4.6750 . 1 1066 136 136 GLU HB2 H 2.1670 . 2 1067 136 136 GLU HB3 H 2.2880 . 2 1068 136 136 GLU HG2 H 2.1380 . 2 1069 136 136 GLU CA C 57.3220 . 1 1070 136 136 GLU CB C 30.6640 . 1 1071 136 136 GLU CG C 33.6710 . 1 1072 136 136 GLU N N 113.9060 . 1 1073 137 137 ARG H H 7.8650 . 1 1074 137 137 ARG HA H 4.0920 . 1 1075 137 137 ARG HB2 H 2.9240 . 2 1076 137 137 ARG HB3 H 2.2220 . 2 1077 137 137 ARG HD2 H 3.6530 . 2 1078 137 137 ARG HG2 H 2.0390 . 2 1079 137 137 ARG HG3 H 2.1590 . 2 1080 137 137 ARG C C 176.9990 . 1 1081 137 137 ARG CA C 61.1540 . 1 1082 137 137 ARG CB C 29.8830 . 1 1083 137 137 ARG CD C 35.9580 . 1 1084 137 137 ARG CG C 29.7100 . 1 1085 137 137 ARG N N 118.2730 . 1 1086 138 138 LEU H H 9.3050 . 1 1087 138 138 LEU HA H 3.4280 . 1 1088 138 138 LEU HB2 H 1.8770 . 2 1089 138 138 LEU HD1 H -1.2350 . 2 1090 138 138 LEU HD2 H -1.0180 . 2 1091 138 138 LEU HG H 0.3420 . 1 1092 138 138 LEU C C 174.6820 . 1 1093 138 138 LEU CA C 58.1730 . 1 1094 138 138 LEU CB C 39.6240 . 1 1095 138 138 LEU CD1 C 19.9160 . 2 1096 138 138 LEU CD2 C 24.8490 . 2 1097 138 138 LEU CG C 26.4140 . 1 1098 138 138 LEU N N 124.2710 . 1 1099 139 139 ARG H H 6.0040 . 1 1100 139 139 ARG HA H 3.3940 . 1 1101 139 139 ARG HB2 H 1.4440 . 2 1102 139 139 ARG HD2 H 2.9920 . 2 1103 139 139 ARG HD3 H 2.8610 . 2 1104 139 139 ARG HG2 H 1.4610 . 2 1105 139 139 ARG C C 174.8890 . 1 1106 139 139 ARG CA C 60.0840 . 1 1107 139 139 ARG CB C 30.2740 . 1 1108 139 139 ARG CD C 40.8230 . 1 1109 139 139 ARG CG C 29.6360 . 1 1110 139 139 ARG N N 114.7480 . 1 1111 140 140 LYS H H 7.5770 . 1 1112 140 140 LYS HA H 3.9320 . 1 1113 140 140 LYS HB2 H 1.8260 . 2 1114 140 140 LYS HD2 H 1.8220 . 2 1115 140 140 LYS HD3 H 1.6310 . 2 1116 140 140 LYS HE2 H 3.8390 . 2 1117 140 140 LYS HG2 H 1.5180 . 2 1118 140 140 LYS HG3 H 1.3780 . 2 1119 140 140 LYS C C 175.4440 . 1 1120 140 140 LYS CA C 59.1930 . 1 1121 140 140 LYS CB C 32.3810 . 1 1122 140 140 LYS CD C 32.3270 . 1 1123 140 140 LYS CE C 39.7640 . 1 1124 140 140 LYS CG C 25.4700 . 1 1125 140 140 LYS N N 116.2160 . 1 1126 141 141 ALA H H 7.6680 . 1 1127 141 141 ALA HA H 4.1120 . 1 1128 141 141 ALA HB H 1.3720 . 1 1129 141 141 ALA C C 176.6970 . 1 1130 141 141 ALA CA C 54.5350 . 1 1131 141 141 ALA CB C 18.6190 . 1 1132 141 141 ALA N N 119.5500 . 1 1133 142 142 VAL H H 7.5770 . 1 1134 142 142 VAL HA H 3.8400 . 1 1135 142 142 VAL HB H 1.8380 . 1 1136 142 142 VAL HG1 H 0.7050 . 2 1137 142 142 VAL HG2 H 0.6250 . 2 1138 142 142 VAL C C 173.6630 . 1 1139 142 142 VAL CA C 63.8180 . 1 1140 142 142 VAL CB C 31.9320 . 1 1141 142 142 VAL CG1 C 23.6820 . 2 1142 142 142 VAL CG2 C 22.3200 . 2 1143 142 142 VAL N N 111.9630 . 1 1144 143 143 GLU H H 7.9680 . 1 1145 143 143 GLU HA H 4.0430 . 1 1146 143 143 GLU HB2 H 1.9780 . 2 1147 143 143 GLU HB3 H 2.0400 . 2 1148 143 143 GLU HG2 H 2.4260 . 2 1149 143 143 GLU C C 171.8160 . 1 1150 143 143 GLU CA C 58.1940 . 1 1151 143 143 GLU CB C 29.7870 . 1 1152 143 143 GLU CG C 37.3640 . 1 1153 143 143 GLU N N 118.9750 . 1 1154 144 144 GLU H H 7.9180 . 1 1155 144 144 GLU HA H 4.1530 . 1 1156 144 144 GLU HB2 H 1.6050 . 2 1157 144 144 GLU HB3 H 1.4890 . 2 1158 144 144 GLU C C 175.2670 . 1 1159 144 144 GLU CA C 55.7800 . 1 1160 144 144 GLU CB C 29.6150 . 1 1161 144 144 GLU N N 118.8930 . 1 1162 145 145 LEU H H 7.7870 . 1 1163 145 145 LEU HA H 4.4590 . 1 1164 145 145 LEU HB2 H 1.7140 . 2 1165 145 145 LEU CA C 61.7520 . 1 1166 145 145 LEU N N 123.5360 . 1 stop_ save_